Acetic Acid → tert-butyl 4-[(2-{4-[(7-chloro-4-methyl-1H-indol-5-yl)amino]-5-cyanopyridin-3-yl}-1-benzofuran-5-yl)methyl]piperazine-1-carboxylate
Reaction equation
[C:49]([O:50][BH-:51]([O:52][C:53](=[O:54])[CH3:55])[O:56][C:57](=[O:58])[CH3:59])(=[O:60])[CH3:61].[CH2:63]1[O:64][CH2:65][CH2:66][CH2:67]1.[CH3:45][C:46](=[O:47])[OH:48].[CH3:68][CH2:69][OH:70].[Cl:1][c:2]1[cH:3][c:4]([NH:12][c:13]2[c:14](-[c:21]3[o:22][c:23]4[c:24]([cH:25]3)[cH:26][c:27]([CH:30]=[O:31])[cH:28][cH:29]4)[cH:15][n:16][cH:17][c:18]2[C:19]#[N:20])[c:5]([CH3:11])[c:6]2[cH:7][cH:8][nH:9][c:10]12.[N:32]1([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1.[Na+:62]>>[Cl:1][c:2]1[cH:3][c:4]([NH:12][c:13]2[c:14](-[c:21]3[o:22][c:23]4[c:24]([cH:25]3)[cH:26][c:27]([CH2:30][N:35]3[CH2:34][CH2:33][N:32]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:37][CH2:36]3)[cH:28][cH:29]4)[cH:15][n:16][cH:17][c:18]2[C:19]#[N:20])[c:5]([CH3:11])[c:6]2[cH:7][cH:8][nH:9][c:10]12Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-7c8e0634b0d34235adc2accbf176341d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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